N-[(2-chlorophenyl)methyl]-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[[6-(3,4-dimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[6-(3,4-dimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(2-chlorobenzyl)-2-[[6-(3,4-dimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCC3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCC3=CC=CC=C3Cl)C

InChI

InChI=1S/C21H20ClN3OS/c1-14-7-8-16(11-15(14)2)19-9-10-21(25-24-19)27-13-20(26)23-12-17-5-3-4-6-18(17)22/h3-11H,12-13H2,1-2H3,(H,23,26)